SCHEMBL20554264

SCHEMBL20554264

COc1c(Oc2ccc(C(F)(F)F)cc2)ccc2c1OCCC2=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
NPBWR1 P48145 3/20 0.37
MAOB P27338 2/20 0.36
MAOA P21397 1/20 0.36
CYP24A1 Q07973 2/20 0.36
CYP26A1 O43174 2/20 0.36
NFE2L2 Q16236 1/20 0.35
MCHR1 Q99705 1/20 0.34
MAPK1 P28482 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20554314 0.87 SLC6A4 (0.38) RAB9AL3MBTL1MAPTLMNAKDM4E
SCHEMBL20554397 0.84 MAOB (0.38) RAB9AL3MBTL1MAPTLMNAMAOB
SCHEMBL20554465 0.84 MAOB (0.44) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL30132649 0.84 MAOB (0.44) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL20554112 0.84 LMNA (0.36) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL30132672 0.81 MAPK14 (0.39) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL20554295 0.81 MAPK14 (0.39) MAPTLMNAKDM4EALDH1A1HPGD
SCHEMBL20554131 0.81 MAOB (0.36) RAB9AALDH1A1HPGDMAOBMAOA
SCHEMBL9464803 0.79 ALDH1A1 (0.57) RAB9AMAPTLMNAKDM4EALDH1A1
SCHEMBL20554109 0.74 L3MBTL1 (0.41) RAB9AL3MBTL1MAPTLMNAKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110770211-B Alpha, beta unsaturated amide compound 协和麒麟株式会社 2023-09-19 CN disclosed
CN-108430972-B Alpha, beta-unsaturated amide compound 协和麒麟株式会社 2022-12-27 CN disclosed
US-11447471-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2022-09-20 US disclosed
US-11332455-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2022-05-17 US disclosed
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND KYOWA KIRIN CO., LTD. (JP) 2021-12-09 US disclosed
US-20210155612-A1 Alpha,Beta-UNSATURATED AMIDE COMPOUND KYOWA KIRIN CO., LTD. (JP) 2021-05-27 US disclosed
US-10787428-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2020-09-29 US disclosed
EP-3712129-A1 ALPHA, BETA-UNSATURATED AMIDE COMPOUND Kyowa Kirin Co., Ltd. (JP) 2020-09-23 EP disclosed
CN-110770211-A α unsaturated amide compound 协和麒麟株式会社 2020-02-07 CN disclosed
US-20190010136-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND KYOWA HAKKO KIRIN CO., LTD. (JP) 2019-01-10 US disclosed
EP-3401309-A1 a, ß UNSATURATED AMIDE COMPOUND Kyowa Hakko Kirin Co., Ltd. (JP) 2018-11-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210155612-A1 Alpha,Beta-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, RXRA RAB9A 3402/4885L3MBTL1 2435/4885MAPT 4512/4885
US-11447471-B2 α,β-unsaturated amide compound NR1H2, RXRA, RXRB RAB9A 3497/4885L3MBTL1 2437/4885MAPT 4590/4885
US-10787428-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 RAB9A 3435/4885L3MBTL1 3176/4885MAPT 4675/4885
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 RAB9A 3287/4885L3MBTL1 3129/4885MAPT 4605/4885
US-11332455-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 RAB9A 3435/4885L3MBTL1 3176/4885MAPT 4675/4885
US-20190010136-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 RAB9A 3287/4885L3MBTL1 3129/4885MAPT 4605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.